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13 similar compounds to monomer 55065

Compile data set for download or QSAR
Wt: 475.2
BDBM37671
Wt: 351.3
BDBM37672
Wt: 456.4
BDBM53349
Wt: 500.4
BDBM55070
Wt: 470.4
BDBM55075
Wt: 456.4
BDBM55076
Wt: 460.4
BDBM55077
Wt: 442.4
BDBM55078
Wt: 414.4
BDBM55079
Wt: 488.4
BDBM58673
Wt: 490.4
BDBM66202
Wt: 458.4
BDBM66210
Wt: 430.4
BDBM64454

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 34 hits for monomerid = 37671,37672,53349,55070,55075,55076,55077,55078,55079,58673,66202,66210,64454   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
fMet-Leu-Phe receptor 1/2


(Homo sapiens (Human))
BDBM37671
PNG
(2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-3-(fura...)
Show SMILES COc1cc(cc(Br)c1O)C1C(C(=O)c2ccco2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C20H15BrN2O7/c1-9-6-14(22-30-9)23-16(10-7-11(21)17(24)13(8-10)28-2)15(19(26)20(23)27)18(25)12-4-3-5-29-12/h3-8,15-16,24H,1-2H3
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3.12E+4n/an/an/an/an/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2NZ862K
More data for this
Ligand-Target Pair
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM37672
PNG
(3-(furan-2-carbonyl)-4-hydroxy-1-(5-methyl-1,2-oxa...)
Show SMILES Cc1cc(no1)N1C(C(C(=O)c2ccco2)C(=O)C1=O)c1cccnc1
Show InChI InChI=1S/C18H13N3O5/c1-10-8-13(20-26-10)21-15(11-4-2-6-19-9-11)14(17(23)18(21)24)16(22)12-5-3-7-25-12/h2-9,14-15H,1H3
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>4.03E+4n/an/an/an/an/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph....


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2DF6PMF
More data for this
Ligand-Target Pair
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM37671
PNG
(2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-3-(fura...)
Show SMILES COc1cc(cc(Br)c1O)C1C(C(=O)c2ccco2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C20H15BrN2O7/c1-9-6-14(22-30-9)23-16(10-7-11(21)17(24)13(8-10)28-2)15(19(26)20(23)27)18(25)12-4-3-5-29-12/h3-8,15-16,24H,1-2H3
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NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph....


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2DF6PMF
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (Human))
BDBM37672
PNG
(3-(furan-2-carbonyl)-4-hydroxy-1-(5-methyl-1,2-oxa...)
Show SMILES Cc1cc(no1)N1C(C(C(=O)c2ccco2)C(=O)C1=O)c1cccnc1
Show InChI InChI=1S/C18H13N3O5/c1-10-8-13(20-26-10)21-15(11-4-2-6-19-9-11)14(17(23)18(21)24)16(22)12-5-3-7-25-12/h2-9,14-15H,1H3
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>4.37E+4n/an/an/an/an/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2NZ862K
More data for this
Ligand-Target Pair
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM37671
PNG
(2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-3-(fura...)
Show SMILES COc1cc(cc(Br)c1O)C1C(C(=O)c2ccco2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C20H15BrN2O7/c1-9-6-14(22-30-9)23-16(10-7-11(21)17(24)13(8-10)28-2)15(19(26)20(23)27)18(25)12-4-3-5-29-12/h3-8,15-16,24H,1-2H3
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n/an/a>6.67E+4n/an/an/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph....


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2DF6PMF
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (Human))
BDBM37672
PNG
(3-(furan-2-carbonyl)-4-hydroxy-1-(5-methyl-1,2-oxa...)
Show SMILES Cc1cc(no1)N1C(C(C(=O)c2ccco2)C(=O)C1=O)c1cccnc1
Show InChI InChI=1S/C18H13N3O5/c1-10-8-13(20-26-10)21-15(11-4-2-6-19-9-11)14(17(23)18(21)24)16(22)12-5-3-7-25-12/h2-9,14-15H,1H3
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NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2J67FB5
More data for this
Ligand-Target Pair
POsterior Segregation family member (pos-1)


(Caenorhabditis elegans)
BDBM53349
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(5-methyl-...)
Show SMILES Cc1cc(no1)N1C(C(C(=O)c2cc3ccccc3o2)C(=O)C1=O)c1cccc(OCC=C)c1
Show InChI InChI=1S/C26H20N2O6/c1-3-11-32-18-9-6-8-17(13-18)23-22(24(29)20-14-16-7-4-5-10-19(16)33-20)25(30)26(31)28(23)21-12-15(2)34-27-21/h3-10,12-14,22-23H,1,11H2,2H3
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n/an/an/an/a 3.00E+5n/an/an/an/a



Broad Institute

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Assay Description
Broad Institute: MLPCN maternal gene expression Project ID: 2024 Keywords: Zinc finger, C. elegans, maternal gene expression, RNA-protein interac...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q28G8J4C
More data for this
Ligand-Target Pair
RecName: Full=Zinc finger protein mex-5


(Caenorhabditis elegans)
BDBM53349
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(5-methyl-...)
Show SMILES Cc1cc(no1)N1C(C(C(=O)c2cc3ccccc3o2)C(=O)C1=O)c1cccc(OCC=C)c1
Show InChI InChI=1S/C26H20N2O6/c1-3-11-32-18-9-6-8-17(13-18)23-22(24(29)20-14-16-7-4-5-10-19(16)33-20)25(30)26(31)28(23)21-12-15(2)34-27-21/h3-10,12-14,22-23H,1,11H2,2H3
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n/an/an/an/a 8.05E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: MLPCN maternal gene expression Project ID: 2024 Keywords: Zinc finger, C. elegans, maternal gene expression, RNA-protein interac...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2D798VP
More data for this
Ligand-Target Pair
NS3


(Hepatitis C virus)
BDBM55070
PNG
(2-(3-methoxy-4-phenylmethoxy-phenyl)-3-(5-methylfu...)
Show SMILES COc1cc(ccc1OCc1ccccc1)C1C(C(=O)c2ccc(C)o2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C28H24N2O7/c1-16-9-11-21(36-16)26(31)24-25(30(28(33)27(24)32)23-13-17(2)37-29-23)19-10-12-20(22(14-19)34-3)35-15-18-7-5-4-6-8-18/h4-14,24-25H,15H2,1-3H3
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n/an/a 2.68E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2XS5ST3
More data for this
Ligand-Target Pair
NS3


(Hepatitis C virus)
BDBM55075
PNG
(3-(5-methylfuran-2-yl)carbonyl-1-(5-methyl-1,2-oxa...)
Show SMILES Cc1ccc(o1)C(=O)C1C(N(C(=O)C1=O)c1cc(C)on1)c1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C27H22N2O6/c1-16-8-13-21(34-16)25(30)23-24(29(27(32)26(23)31)22-14-17(2)35-28-22)19-9-11-20(12-10-19)33-15-18-6-4-3-5-7-18/h3-14,23-24H,15H2,1-2H3
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n/an/a 1.74E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2XS5ST3
More data for this
Ligand-Target Pair
NS3


(Hepatitis C virus)
BDBM55076
PNG
(3-(5-methylfuran-2-yl)carbonyl-1-(5-methyl-1,2-oxa...)
Show SMILES Cc1ccc(o1)C(=O)C1C(N(C(=O)C1=O)c1cc(C)on1)c1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C26H20N2O6/c1-15-11-12-20(32-15)24(29)22-23(28(26(31)25(22)30)21-13-16(2)34-27-21)17-7-6-10-19(14-17)33-18-8-4-3-5-9-18/h3-14,22-23H,1-2H3
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n/an/a 1.95E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

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Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2XS5ST3
More data for this
Ligand-Target Pair
NS3


(Hepatitis C virus)
BDBM55077
PNG
(3-(1-benzofuran-2-carbonyl)-2-(3,4-dimethoxyphenyl...)
Show SMILES COc1ccc(cc1OC)C1C(C(=O)c2cc3ccccc3o2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C25H20N2O7/c1-13-10-20(26-34-13)27-22(15-8-9-17(31-2)18(12-15)32-3)21(24(29)25(27)30)23(28)19-11-14-6-4-5-7-16(14)33-19/h4-12,21-22H,1-3H3
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n/an/a 4.98E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2XS5ST3
More data for this
Ligand-Target Pair
NS3


(Hepatitis C virus)
BDBM55078
PNG
(3-(furan-2-carbonyl)-4-hydroxy-1-(5-methyl-1,2-oxa...)
Show SMILES Cc1cc(no1)N1C(C(C(=O)c2ccco2)C(=O)C1=O)c1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C25H18N2O6/c1-15-13-20(26-33-15)27-22(21(24(29)25(27)30)23(28)19-11-6-12-31-19)16-7-5-10-18(14-16)32-17-8-3-2-4-9-17/h2-14,21-22H,1H3
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n/an/a 2.64E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2XS5ST3
More data for this
Ligand-Target Pair
NS3


(Hepatitis C virus)
BDBM55079
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(5-methyl-...)
Show SMILES Cc1cc(no1)N1C(C(C(=O)c2cc3ccccc3o2)C(=O)C1=O)c1ccc(C)cc1
Show InChI InChI=1S/C24H18N2O5/c1-13-7-9-15(10-8-13)21-20(22(27)18-12-16-5-3-4-6-17(16)30-18)23(28)24(29)26(21)19-11-14(2)31-25-19/h3-12,20-21H,1-2H3
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n/an/a 2.49E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2XS5ST3
More data for this
Ligand-Target Pair
streptokinase A precursor


(Streptococcus pyogenes M1 GAS)
BDBM58673
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-2-(3-methoxy...)
Show SMILES CCCOc1ccc(cc1OC)C1C(C(=O)c2cc3ccccc3o2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C27H24N2O7/c1-4-11-34-19-10-9-17(14-20(19)33-3)24-23(25(30)21-13-16-7-5-6-8-18(16)35-21)26(31)27(32)29(24)22-12-15(2)36-28-22/h5-10,12-14,23-24H,4,11H2,1-3H3
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n/an/an/an/a 1.50E+5n/an/an/an/a



Broad Institute

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Assay Description
Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2736PBV
More data for this
Ligand-Target Pair
streptokinase A precursor


(Streptococcus pyogenes M1 GAS)
BDBM55079
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(5-methyl-...)
Show SMILES Cc1cc(no1)N1C(C(C(=O)c2cc3ccccc3o2)C(=O)C1=O)c1ccc(C)cc1
Show InChI InChI=1S/C24H18N2O5/c1-13-7-9-15(10-8-13)21-20(22(27)18-12-16-5-3-4-6-17(16)30-18)23(28)24(29)26(21)19-11-14(2)31-25-19/h3-12,20-21H,1-2H3
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n/an/an/an/a 6.30E+3n/an/an/an/a



Broad Institute

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Assay Description
Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2736PBV
More data for this
Ligand-Target Pair
Hsf1 protein


(Mus musculus)
BDBM64454
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-2-(3-methoxy...)
Show SMILES COc1cccc(c1)C1C(C(=O)c2cc3ccccc3o2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C24H18N2O6/c1-13-10-19(25-32-13)26-21(15-7-5-8-16(11-15)30-2)20(23(28)24(26)29)22(27)18-12-14-6-3-4-9-17(14)31-18/h3-12,20-21H,1-2H3
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n/an/an/an/a>1.95E+5n/an/an/an/a



Broad Institute

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Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens (Human))
BDBM66202
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(5-methyl-...)
Show SMILES COc1cc(cc(OC)c1OC)C1C(C(=O)c2cc3ccccc3o2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C26H22N2O8/c1-13-9-20(27-36-13)28-22(15-11-18(32-2)25(34-4)19(12-15)33-3)21(24(30)26(28)31)23(29)17-10-14-7-5-6-8-16(14)35-17/h5-12,21-22H,1-4H3
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n/an/a>3.98E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

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Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2D21W22
More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens (Human))
BDBM66210
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(5-methyl-...)
Show SMILES CCCOc1cccc(c1)C1C(C(=O)c2cc3ccccc3o2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C26H22N2O6/c1-3-11-32-18-9-6-8-17(13-18)23-22(24(29)20-14-16-7-4-5-10-19(16)33-20)25(30)26(31)28(23)21-12-15(2)34-27-21/h4-10,12-14,22-23H,3,11H2,1-2H3
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The Scripps Research Institute Molecular Screening Center

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Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2D21W22
More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens (Human))
BDBM53349
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(5-methyl-...)
Show SMILES Cc1cc(no1)N1C(C(C(=O)c2cc3ccccc3o2)C(=O)C1=O)c1cccc(OCC=C)c1
Show InChI InChI=1S/C26H20N2O6/c1-3-11-32-18-9-6-8-17(13-18)23-22(24(29)20-14-16-7-4-5-10-19(16)33-20)25(30)26(31)28(23)21-12-15(2)34-27-21/h3-10,12-14,22-23H,1,11H2,2H3
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n/an/a>3.98E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2D21W22
More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens (Human))
BDBM55079
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(5-methyl-...)
Show SMILES Cc1cc(no1)N1C(C(C(=O)c2cc3ccccc3o2)C(=O)C1=O)c1ccc(C)cc1
Show InChI InChI=1S/C24H18N2O5/c1-13-7-9-15(10-8-13)21-20(22(27)18-12-16-5-3-4-6-17(16)30-18)23(28)24(29)26(21)19-11-14(2)31-25-19/h3-12,20-21H,1-2H3
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n/an/a>3.98E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2D21W22
More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens (Human))
BDBM64454
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-2-(3-methoxy...)
Show SMILES COc1cccc(c1)C1C(C(=O)c2cc3ccccc3o2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C24H18N2O6/c1-13-10-19(25-32-13)26-21(15-7-5-8-16(11-15)30-2)20(23(28)24(26)29)22(27)18-12-14-6-3-4-9-17(14)31-18/h3-12,20-21H,1-2H3
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The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2D21W22
More data for this
Ligand-Target Pair
nuclear receptor corepressor 2 isoform 2


(Homo sapiens (Human))
BDBM66202
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(5-methyl-...)
Show SMILES COc1cc(cc(OC)c1OC)C1C(C(=O)c2cc3ccccc3o2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C26H22N2O8/c1-13-9-20(27-36-13)28-22(15-11-18(32-2)25(34-4)19(12-15)33-3)21(24(30)26(28)31)23(29)17-10-14-7-5-6-8-16(14)35-17/h5-12,21-22H,1-4H3
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n/an/a 4.11E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q28914BQ
More data for this
Ligand-Target Pair
nuclear receptor corepressor 2 isoform 2


(Homo sapiens (Human))
BDBM66210
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(5-methyl-...)
Show SMILES CCCOc1cccc(c1)C1C(C(=O)c2cc3ccccc3o2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C26H22N2O6/c1-3-11-32-18-9-6-8-17(13-18)23-22(24(29)20-14-16-7-4-5-10-19(16)33-20)25(30)26(31)28(23)21-12-15(2)34-27-21/h4-10,12-14,22-23H,3,11H2,1-2H3
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n/an/a 3.69E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q28914BQ
More data for this
Ligand-Target Pair
nuclear receptor corepressor 2 isoform 2


(Homo sapiens (Human))
BDBM53349
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(5-methyl-...)
Show SMILES Cc1cc(no1)N1C(C(C(=O)c2cc3ccccc3o2)C(=O)C1=O)c1cccc(OCC=C)c1
Show InChI InChI=1S/C26H20N2O6/c1-3-11-32-18-9-6-8-17(13-18)23-22(24(29)20-14-16-7-4-5-10-19(16)33-20)25(30)26(31)28(23)21-12-15(2)34-27-21/h3-10,12-14,22-23H,1,11H2,2H3
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n/an/a 3.32E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q28914BQ
More data for this
Ligand-Target Pair
nuclear receptor corepressor 2 isoform 2


(Homo sapiens (Human))
BDBM55079
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(5-methyl-...)
Show SMILES Cc1cc(no1)N1C(C(C(=O)c2cc3ccccc3o2)C(=O)C1=O)c1ccc(C)cc1
Show InChI InChI=1S/C24H18N2O5/c1-13-7-9-15(10-8-13)21-20(22(27)18-12-16-5-3-4-6-17(16)30-18)23(28)24(29)26(21)19-11-14(2)31-25-19/h3-12,20-21H,1-2H3
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n/an/a 2.33E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q28914BQ
More data for this
Ligand-Target Pair
nuclear receptor corepressor 2 isoform 2


(Homo sapiens (Human))
BDBM64454
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-2-(3-methoxy...)
Show SMILES COc1cccc(c1)C1C(C(=O)c2cc3ccccc3o2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C24H18N2O6/c1-13-10-19(25-32-13)26-21(15-7-5-8-16(11-15)30-2)20(23(28)24(26)29)22(27)18-12-14-6-3-4-9-17(14)31-18/h3-12,20-21H,1-2H3
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n/an/a 3.70E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q28914BQ
More data for this
Ligand-Target Pair
Hsf1 protein


(Mus musculus)
BDBM66202
PNG
(3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(5-methyl-...)
Show SMILES COc1cc(cc(OC)c1OC)C1C(C(=O)c2cc3ccccc3o2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C26H22N2O8/c1-13-9-20(27-36-13)28-22(15-11-18(32-2)25(34-4)19(12-15)33-3)21(24(30)26(28)31)23(29)17-10-14-7-5-6-8-16(14)35-17/h5-12,21-22H,1-4H3
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2P55KXK
More data for this
Ligand-Target Pair
corticotropin releasing factor-binding protein


(Homo sapiens (Human))
BDBM37671
PNG
(2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-3-(fura...)
Show SMILES COc1cc(cc(Br)c1O)C1C(C(=O)c2ccco2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C20H15BrN2O7/c1-9-6-14(22-30-9)23-16(10-7-11(21)17(24)13(8-10)28-2)15(19(26)20(23)27)18(25)12-4-3-5-29-12/h3-8,15-16,24H,1-2H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2VX0F3D
More data for this
Ligand-Target Pair
hypothetical protein SA1422


(Staphylococcus aureus subsp. aureus N315)
BDBM55075
PNG
(3-(5-methylfuran-2-yl)carbonyl-1-(5-methyl-1,2-oxa...)
Show SMILES Cc1ccc(o1)C(=O)C1C(N(C(=O)C1=O)c1cc(C)on1)c1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C27H22N2O6/c1-16-8-13-21(34-16)25(30)23-24(29(27(32)26(23)31)22-14-17(2)35-28-22)19-9-11-20(12-10-19)33-15-18-6-4-3-5-7-18/h3-14,23-24H,15H2,1-2H3
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n/an/a 2.89E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2BV7F7H
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase (LMWPTP)


(Homo sapiens (Human))
BDBM55075
PNG
(3-(5-methylfuran-2-yl)carbonyl-1-(5-methyl-1,2-oxa...)
Show SMILES Cc1ccc(o1)C(=O)C1C(N(C(=O)C1=O)c1cc(C)on1)c1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C27H22N2O6/c1-16-8-13-21(34-16)25(30)23-24(29(27(32)26(23)31)22-14-17(2)35-28-22)19-9-11-20(12-10-19)33-15-18-6-4-3-5-7-18/h3-14,23-24H,15H2,1-2H3
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n/an/a 2.98E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2GM85XC
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase (LMWPTP)


(Homo sapiens (Human))
BDBM55075
PNG
(3-(5-methylfuran-2-yl)carbonyl-1-(5-methyl-1,2-oxa...)
Show SMILES Cc1ccc(o1)C(=O)C1C(N(C(=O)C1=O)c1cc(C)on1)c1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C27H22N2O6/c1-16-8-13-21(34-16)25(30)23-24(29(27(32)26(23)31)22-14-17(2)35-28-22)19-9-11-20(12-10-19)33-15-18-6-4-3-5-7-18/h3-14,23-24H,15H2,1-2H3
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n/an/a>8.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2JD4VDZ
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (Human))
BDBM37671
PNG
(2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-3-(fura...)
Show SMILES COc1cc(cc(Br)c1O)C1C(C(=O)c2ccco2)C(=O)C(=O)N1c1cc(C)on1
Show InChI InChI=1S/C20H15BrN2O7/c1-9-6-14(22-30-9)23-16(10-7-11(21)17(24)13(8-10)28-2)15(19(26)20(23)27)18(25)12-4-3-5-29-12/h3-8,15-16,24H,1-2H3
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n/an/a 4.77E+4n/an/an/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2J67FB5
More data for this
Ligand-Target Pair
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM37672
PNG
(3-(furan-2-carbonyl)-4-hydroxy-1-(5-methyl-1,2-oxa...)
Show SMILES Cc1cc(no1)N1C(C(C(=O)c2ccco2)C(=O)C1=O)c1cccnc1
Show InChI InChI=1S/C18H13N3O5/c1-10-8-13(20-26-10)21-15(11-4-2-6-19-9-11)14(17(23)18(21)24)16(22)12-5-3-7-25-12/h2-9,14-15H,1H3
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n/an/a>6.67E+4n/an/an/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph....


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2DF6PMF
More data for this
Ligand-Target Pair